Vitas-M small molecule compound
(2E)-3-(4,7-dimethoxy-1,3-benzodioxol-5-yl)-1-(3-ethoxyphenyl)prop-2-en-1-one
Catalog ID
STK693745
SMILES CCOc1cccc(c1)C(=O)/C=C/c1cc(OC)c2c(c1OC)OCO2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C20H20O6 MW 356.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20O6/c1-4-24-15-7-5-6-13(10-15)16(21)9-8-14-11-17(22-2)19-20(18(14)23-3)26-12-25-19/h5-11H,4,12H2,1-3H3/b9-8+InChIKey
HHWKZSVXBWNDBY-CMDGGOBGSA-NSynonyms
(2E)3(47DIMETHOXY(2HBENZO(D)13DIOXOLEN5YL))1(3ETHOXYPHENYL)PROP2EN1ONE
(2E)3(47dimethoxy13benzodioxol5yl)1(3ethoxyphenyl)prop2en1one
(E)3(47dimethoxy13benzodioxol5yl)1(3ethoxyphenyl)prop2en1one
CCOC1=CC=CC(=C1)C(=O)C=CC2=CC(=C3C(=C2OC)OCO3)OC
CCOc1cccc(c1)C(=O)C=Cc1cc(OC)c2c(c1OC)OCO2
InChI=1SC20H20O6c14241575613(1015)16(21)98141117(222)1920(18(14)233)26122519h511H412H213H3b98+
MFCD12033830
ZINC000015108104
ZINC15108104
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